2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide

C19H23NO2 — CID 132650068

IUPAC2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(C)NC(=O)COc2cccc(C)c2C)cc1
InChIInChI=1S/C19H23NO2/c1-13-8-10-17(11-9-13)16(4)20-19(21)12-22-18-7-5-6-14(2)15(18)3/h5-11,16H,12H2,1-4H3,(H,20,21)
InChIKeyHOYWEKGTSZJNKM-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.87
Rot. Bonds5

About 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide

2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide (PubChem CID 132650068) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide
PubChem CID132650068
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(C)NC(=O)COc2cccc(C)c2C)cc1
InChIInChI=1S/C19H23NO2/c1-13-8-10-17(11-9-13)16(4)20-19(21)12-22-18-7-5-6-14(2)15(18)3/h5-11,16H,12H2,1-4H3,(H,20,21)
InChIKeyHOYWEKGTSZJNKM-UHFFFAOYSA-N
XLogP3.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dimethylphenoxy)-N-(1-phenylethyl)acetamide
CID 19172570
2-(2-methylphenoxy)-N-[(1S)-1-(4-methylphenyl)ethyl]acetamide
CID 94012505
2-(2,3-dimethylphenoxy)-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 17326921
[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982164
N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2,3-dimethylphenoxy)acetamide
CID 45155077
(2S)-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]propanoic acid
CID 9156872
N-[(2R)-butan-2-yl]-2-(2,3-dimethylphenoxy)acetamide
CID 728123
2-(2-methylphenoxy)-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide
CID 18096211
2-(2,3-dimethylphenoxy)-N-pentan-2-ylacetamide
CID 50945244
(2S)-2-[[2-(2,3-dimethylphenoxy)acetyl]amino]propanoate
CID 9156871
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(2-methylphenoxy)acetamide
CID 94843850
2-(3-methylphenoxy)-N-[(1R)-1-(4-methylphenyl)ethyl]acetamide
CID 99132930

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide (CID 132650068) is 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide is Cc1ccc(C(C)NC(=O)COc2cccc(C)c2C)cc1.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide?
The InChIKey is HOYWEKGTSZJNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-13-8-10-17(11-9-13)16(4)20-19(21)12-22-18-7-5-6-14(2)15(18)3/h5-11,16H,12H2,1-4H3,(H,20,21).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide?
2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-[1-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 132650068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).